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CHEBI:218841 - Obscurolide A4

ChEBI IDCHEBI:218841
ChEBI NameObscurolide A4
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H21NO4
Net Charge0
Average Mass291.347
Monoisotopic Mass291.14706
SMILESCOCc1ccc(NC2CC(=O)OC2/C=C/C(C)O)cc1
InChIInChI=1S/C16H21NO4/c1-11(18)3-8-15-14(9-16(19)21-15)17-13-6-4-12(5-7-13)10-20-2/h3-8,11,14-15,17-18H,9-10H2,1-2H3/b8-3+
InChIKeyHYRHDNDBYPEHPQ-FPYGCLRLSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (1325435)
ChEBI Ontology
Outgoing Relation(s)
Obscurolide A4 (CHEBI:218841) is a benzyl ether (CHEBI:59859)
IUPAC Name 
5-[(E)-3-hydroxybut-1-enyl]-4-[4-(methoxymethyl)anilino]oxolan-2-one
Manual XrefsDatabases
4943222ChemSpider